input word = C00053113

Metabolite InformationStructural formula
Name Cerotic acid, methyl ester
Methyl hexacosanoate
Formula C27H54O2
Mw 410.41238097
CAS RN 5802-82-4
C_ID C00053113
InChIKey VHUJBYYFFWDLNM-UHFFFAOYSA-N
InChICode InChI=1S/C27H54O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(28)29-2/h3-26H2,1-2H3
SMILES CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePinus sibirica Ref.
PlantaeRutaceaeRuta graveolens Ref.
PlantaeSolanaceaeSolanum tuberosum Ref.
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OrganismPinus sibirica
ReferenceShpatov, A. V. et al., Chem. Biodiv., 14, (2017), e1600203.